Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 5/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | GHSR | Q92847 | 9/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.33 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | PARP1 | P09874 | 1/20 | 0.32 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL6441789 | 1.00 | CYP2C19 (0.45) | CYP2C19CYP2D6CYP2C9CYP3A4GHSR | |
| SCHEMBL6441464 | 0.91 | CYP2C19 (0.49) | CYP2C19CYP2D6CYP2C9CYP3A4GHSR | |
| SCHEMBL6441468 | 0.91 | CYP2C19 (0.49) | CYP2C19CYP2D6CYP2C9CYP3A4GHSR | |
| SCHEMBL6441395 | 0.89 | L3MBTL1 (0.39) | CYP2C19CYP2D6CYP2C9CYP3A4SMN1; SMN2 | |
| SCHEMBL6442547 | 0.87 | CYP2C19 (0.48) | CYP2C19CYP2D6CYP2C9CYP3A4GHSR | |
| SCHEMBL6442544 | 0.87 | CYP2C19 (0.48) | CYP2C19CYP2D6CYP2C9CYP3A4GHSR | |
| SCHEMBL6442629 | 0.84 | CYP2C19 (0.52) | CYP2C19CYP2D6CYP2C9CYP3A4GHSR | |
| SCHEMBL6442632 | 0.84 | CYP2C19 (0.52) | CYP2C19CYP2D6CYP2C9CYP3A4GHSR | |
| SCHEMBL6442483 | 0.84 | CYP2C19 (0.48) | CYP2C19CYP2D6CYP2C9CYP3A4GHSR | |
| SCHEMBL6442488 | 0.84 | CYP2C19 (0.48) | CYP2C19CYP2D6CYP2C9CYP3A4GHSR |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2002004440-A9 | COMPOSITION AND ANTIVIRAL ACTIVITY OF SUBSTITUTED INDOLEOXOACETIC PIPERAZINE DERIVATIVES | BRISTOL MYERS SQUIBB CO (US) | 2005-11-03 | — | — | WO | claimed |
| EP-1299382-B1 | COMPOSITION AND ANTIVIRAL ACTIVITY OF SUBSTITUTED INDOLEOXOACETIC PIPERAZINE DERIVATIVES | BRISTOL MYERS SQUIBB CO (US) | 2005-09-21 | — | — | EP | claimed |
| EP-1299382-A4 | COMPOSITION AND ANTIVIRAL ACTIVITY OF SUBSTITUTED INDOLEOXOACETIC PIPERAZINE DERIVATIVES | BRISTOL MYERS SQUIBB CO (US) | 2004-02-11 | — | — | EP | claimed |
| US-6573262-B2 | Compounds for treating mammals infected with HIV virus | BRISTOL-MYERS SQIBB COMPANY | 2003-06-03 | — | — | US | claimed |
| EP-1299382-A1 | COMPOSITION AND ANTIVIRAL ACTIVITY OF SUBSTITUTED INDOLEOXOACETIC PIPERAZINE DERIVATIVES | BRISTOL-MYERS SQUIBB COMPANY (US) | 2003-04-09 | — | — | EP | claimed |
| WO-2002004440-A1 | COMPOSITION AND ANTIVIRAL ACTIVITY OF SUBSTITUTED INDOLEOXOACETIC PIPERAZINE DERIVATIVES | BRISTOL-MYERS SQUIBB COMPANY (US) | 2002-01-17 | — | — | WO | claimed |